methanesulfonic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzenecarboximidamide

Systemtic Name: methanesulfonic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzenecarboximidamide Openeye Name: methanesulfonic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzamidine CAS Name: methanesulfonic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzenecarboximidamide IUPAC Name: methanesulfonic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzenecarboximidamide Traditional Name: mesylic acid; 4-[4-(2-methoxyphenoxy)butoxy]benzamidine Formula: C19H26N2O6S MolecularWeight: 410.48454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCCCOC2=CC=C(C=C2)C(=N)N.CS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1OCCCCOC2=CC=C(C=C2)C(=N)N.CS(=O)(=O)O

InChI

InChI=1S/C18H22N2O3.CH4O3S/c1-21-16-6-2-3-7-17(16)23-13-5-4-12-22-15-10-8-14(9-11-15)18(19)20;1-5(2,3)4/h2-3,6-11H,4-5,12-13H2,1H3,(H3,19,20);1H3,(H,2,3,4)